SCHEMBL27184993

SCHEMBL27184993

Cc1ncc(NC(=O)CC2CN(C(=O)OC(C)(C)C)C2)cc1NC(=O)c1cnn2cc(-c3cnn4c3CCC4)sc12

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLQ O75417 1/20 0.35
▸ GLS O94925 4/20 0.34
▸ TP53 P04637 3/20 0.34
▸ MAPT P10636 2/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ CDK9 P50750 1/20 0.33
▸ GAA P10253 1/20 0.32
▸ JAK2 O60674 5/20 0.32
▸ JAK1 P23458 5/20 0.32
▸ NTRK1 P04629 1/20 0.31
▸ KIT P10721 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29760088 1.00 POLQ (0.35) POLQGLSTP53MAPTIRAK4
SCHEMBL24578989 0.89 POLQ (0.37) POLQCDK9NTRK1KIT
SCHEMBL29759606 0.89 POLQ (0.37) POLQCDK9NTRK1KIT
SCHEMBL29759976 0.87 POLQ (0.37) POLQCDK9NTRK1KIT
SCHEMBL27185213 0.87 POLQ (0.37) POLQCDK9NTRK1KIT
SCHEMBL29759651 0.85 IDO1 (0.36) GLSTP53MAPTIRAK4GAA
SCHEMBL27185073 0.85 IDO1 (0.36) GLSTP53MAPTIRAK4GAA
SCHEMBL29760080 0.84 POLQ (0.39) POLQCDK9NTRK1KIT
SCHEMBL27185204 0.84 POLQ (0.39) POLQCDK9NTRK1KIT
SCHEMBL29760155 0.83 POLQ (0.37) POLQNTRK1KIT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS ACTELION PHARMACEUTICALS LTD (CH) 2024-04-04 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20240109917-A1 PYRAZOLOTHIAZOLE CARBOXAMIDES AND THEIR USES AS PDGFR INHIBITORS PDGFRA, PDGFRB, ABL1 POLQ 2881/4885GLS 124/4885TP53 601/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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